3-Bromo-4-methyl-γ-oxobenzenebutanoic acid
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3-Bromo-4-methyl-γ-oxobenzenebutanoic acid
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CAS No:
62903-07-5
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Formula:
C11H11BrO3
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Chemical Name:
3-Bromo-4-methyl-γ-oxobenzenebutanoic acid
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Synonyms:
Benzenebutanoic acid,3-bromo-4-methyl-γ-oxo-;3-Bromo-4-methyl-γ-oxobenzenebutanoic acid
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CAS No:
Characteristics
54.4
2.80500
1.497g/cm3
163-171 °C @ Solvent: Acetonitrile
438.2ºC at 760 mmHg
218.8ºC
1.572
Computed Properties
Molecular Weight:271.11
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:269.98916
Monoisotopic Mass:269.98916
Topological Polar Surface Area:54.4
Heavy Atom Count:15
Complexity:252
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Bromo-4-methyl-γ-oxobenzenebutanoic acid
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